(3β,5Alpha,8Xi,9Xi,14Xi,17β)-17-Acetamidoandrostan-3-Yl {4-[Bis(2-Chloroethyl)Amino]Phenyl}Acetate
Properties
| Property | Value |
|---|---|
| Formula | C33H48Cl2N2O3 |
| IUPAC Name | [(3s,5s,8s,9r,10s,13s,14r,17s)-17-acetamido-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-3-yl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate |
| Molecular Mass | 591.652 g·mol−1 |
| Heat of Formation | 4802.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 23.45 ± 1.08 D |
| Volume | 511.6 Å 3 |
| Surface Area | 421.29 Å 2 |
| HOMO Energy | -8.51 ± 0.55 eV |
| LUMO Energy | -3.31 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BLLAWDFADRSHFN-IFTNYECZSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C N O Cl |